Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hre_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLN 6.A OE1 no hydrogen 2.824 N/A SER 3.A OG GLN 6.A OE1 no hydrogen 3.364 N/A GLN 6.A N SER 3.A OG no hydrogen 3.027 N/A GLN 6.A NE2 LEU 34.A O no hydrogen 2.893 N/A GLN 7.A N SER 3.A O no hydrogen 2.908 N/A LYS 8.A N ALA 4.A O no hydrogen 3.019 N/A LEU 9.A N VAL 5.A O no hydrogen 2.951 N/A ALA 10.A N GLN 6.A O no hydrogen 2.937 N/A ALA 11.A N GLN 7.A O no hydrogen 2.980 N/A LEU 12.A N LYS 8.A O no hydrogen 2.908 N/A GLU 13.A N LEU 9.A O no hydrogen 2.891 N/A LYS 14.A N ALA 10.A O no hydrogen 2.860 N/A SER 15.A N ALA 11.A O no hydrogen 3.184 N/A SER 15.A OG.A ALA 11.A O no hydrogen 3.102 N/A SER 15.A OG.B ALA 11.A O no hydrogen 3.401 N/A SER 15.A OG.B LEU 12.A O no hydrogen 2.920 N/A SER 16.A N LEU 12.A O no hydrogen 3.092 N/A SER 16.A N GLU 13.A O no hydrogen 3.098 N/A SER 16.A OG GLU 13.A O no hydrogen 2.679 N/A GLY 17.A N GLU 13.A O no hydrogen 3.222 N/A GLY 18.A N SER 16.A OG no hydrogen 3.099 N/A ARG 19.A N THR 239.A O no hydrogen 2.847 N/A ARG 19.A NH1 GLU 39.A OE1 no hydrogen 3.037 N/A ARG 19.A NH1 ARG 40.A O no hydrogen 3.011 N/A ARG 19.A NH2 ARG 40.A O no hydrogen 3.015 N/A LEU 20.A N GLU 13.A OE2 no hydrogen 2.825 N/A GLY 21.A N TYR 237.A O no hydrogen 2.795 N/A VAL 22.A N TYR 35.A O no hydrogen 2.829 N/A ALA 23.A N VAL 235.A O no hydrogen 3.035 N/A LEU 24.A N VAL 33.A O no hydrogen 2.815 N/A ILE 25.A N VAL 233.A O no hydrogen 2.864 N/A ASP 26.A N THR 31.A O no hydrogen 2.933 N/A THR 27.A N PRO 231.A O no hydrogen 3.032 N/A THR 27.A OG1 PRO 231.A O no hydrogen 2.591 N/A ALA 28.A N ASP 26.A OD1 no hydrogen 2.861 N/A ASP 29.A N ASP 26.A O no hydrogen 3.311 N/A ASN 30.A N ASP 26.A O no hydrogen 2.696 N/A THR 31.A N ASP 29.A OD1 no hydrogen 3.006 N/A THR 31.A OG1 ASP 29.A OD1 no hydrogen 2.647 N/A THR 31.A OG1 ASP 29.A OD2 no hydrogen 3.385 N/A VAL 33.A N LEU 24.A O no hydrogen 3.055 N/A TYR 35.A N VAL 22.A O no hydrogen 2.864 N/A TYR 35.A OH GLU 13.A OE1 no hydrogen 2.616 N/A ARG 36.A NE GLU 13.A OE1 no hydrogen 3.437 N/A ARG 36.A NE GLU 13.A OE2 no hydrogen 2.766 N/A ARG 36.A NH1 GLU 39.A OE2 no hydrogen 2.878 N/A ARG 36.A NH2 GLU 13.A OE1 no hydrogen 2.873 N/A GLU 39.A N ARG 36.A O no hydrogen 3.162 N/A ARG 40.A NH1 THR 134.A O no hydrogen 3.015 N/A ARG 40.A NH1 THR 155.A OG1 no hydrogen 2.959 N/A ARG 40.A NH2 THR 134.A O no hydrogen 2.940 N/A PHE 41.A N THR 156.A O no hydrogen 2.901 N/A MET 43.A N ASP 154.A O no hydrogen 3.008 N/A THR 46.A N MET 43.A O no hydrogen 3.122 N/A THR 46.A OG1 MET 43.A O no hydrogen 2.752 N/A THR 46.A OG1 TYR 237.A OH no hydrogen 2.932 N/A SER 47.A N CYS 44.A O no hydrogen 3.053 N/A SER 47.A OG CYS 44.A O no hydrogen 2.816 N/A LYS 48.A N GLY 45.A O no hydrogen 2.938 N/A LYS 48.A NZ SER 105.A O no hydrogen 2.966 N/A LYS 48.A NZ ASN 107.A OD1 no hydrogen 2.699 N/A VAL 49.A N THR 46.A O no hydrogen 3.277 N/A ALA 51.A N SER 47.A O no hydrogen 3.254 N/A ALA 52.A N LYS 48.A O no hydrogen 2.952 N/A ALA 53.A N VAL 49.A O no hydrogen 2.902 N/A ALA 54.A N MET 50.A O no hydrogen 2.904 N/A VAL 55.A N ALA 51.A O no hydrogen 3.166 N/A LEU 56.A N ALA 52.A O no hydrogen 2.909 N/A LYS 57.A N ALA 53.A O no hydrogen 2.874 N/A LYS 57.A NZ GLU 60.A OE1 no hydrogen 2.961 N/A LYS 57.A NZ GLU 60.A OE2 no hydrogen 3.116 N/A LYS 57.A NZ ALA 173.A O no hydrogen 2.961 N/A GLN 58.A N ALA 54.A O no hydrogen 3.081 N/A SER 59.A N VAL 55.A O no hydrogen 2.940 N/A SER 59.A OG LEU 56.A O no hydrogen 2.571 N/A GLU 60.A N LYS 57.A O no hydrogen 3.049 N/A THR 61.A N GLN 58.A O no hydrogen 3.237 N/A THR 61.A OG1 GLN 58.A O no hydrogen 3.334 N/A GLN 62.A N SER 59.A O no hydrogen 3.179 N/A LEU 65.A N GLN 62.A O no hydrogen 3.019 N/A ASN 67.A N GLN 64.A O no hydrogen 2.989 N/A ASN 67.A ND2 GLN 64.A OE1 no hydrogen 3.150 N/A GLN 68.A N LEU 65.A O no hydrogen 3.180 N/A VAL 70.A N MET 92.A O no hydrogen 2.782 N/A ILE 72.A N GLY 90.A O no hydrogen 2.994 N/A LYS 73.A N ASP 76.A OD2 no hydrogen 2.757 N/A ASP 76.A N LYS 73.A O no hydrogen 2.793 N/A LEU 77.A N PRO 74.A O no hydrogen 3.286 N/A VAL 78.A N ASN 81.A OD1 no hydrogen 2.750 N/A VAL 78.A N THR 108.A OG1 no hydrogen 3.365 N/A ILE 83.A N ASP 106.A OD2 no hydrogen 2.848 N/A ALA 84.A N ASP 106.A OD2 no hydrogen 2.869 N/A GLU 85.A N ASN 81.A O no hydrogen 3.055 N/A LYS 86.A N ILE 83.A O no hydrogen 3.098 N/A HIS 87.A N ALA 84.A O no hydrogen 2.883 N/A ASN 89.A N ILE 72.A O no hydrogen 2.656 N/A GLY 90.A N HIS 87.A O no hydrogen 2.833 N/A MET 92.A N VAL 70.A O no hydrogen 2.910 N/A THR 93.A N GLU 96.A OE2 no hydrogen 2.876 N/A THR 93.A OG1 LEU 66.A O no hydrogen 3.182 N/A ALA 95.A N LEU 66.A O no hydrogen 3.034 N/A GLU 96.A N THR 93.A OG1 no hydrogen 3.083 N/A LEU 97.A N THR 93.A O no hydrogen 2.829 N/A SER 98.A N LEU 94.A O no hydrogen 2.865 N/A SER 98.A OG LEU 94.A O no hydrogen 2.852 N/A ALA 99.A N ALA 95.A O no hydrogen 2.914 N/A ALA 100.A N GLU 96.A O no hydrogen 2.915 N/A ALA 101.A N LEU 97.A O no hydrogen 2.898 N/A LEU 102.A N SER 98.A O no hydrogen 2.954 N/A GLN 103.A N ALA 99.A O no hydrogen 2.818 N/A GLN 103.A NE2 TRP 185.A O no hydrogen 2.893 N/A TYR 104.A N ALA 100.A O no hydrogen 3.051 N/A ASP 106.A N ALA 100.A O no hydrogen 3.118 N/A ASN 107.A N TYR 80.A O no hydrogen 2.858 N/A ASN 107.A ND2 ASN 79.A OD1 no hydrogen 2.770 N/A THR 108.A OG1 ASP 76.A O no hydrogen 3.156 N/A THR 108.A OG1 ASN 81.A OD1 no hydrogen 2.831 N/A ALA 109.A N ASP 106.A OD1 no hydrogen 2.883 N/A MET 110.A N ASP 106.A O no hydrogen 3.124 N/A ASN 111.A N ASN 107.A O no hydrogen 3.017 N/A ASN 111.A ND2 GLU 141.A O no hydrogen 2.954 N/A LYS 112.A N THR 108.A O no hydrogen 3.059 N/A LYS 112.A NZ GLU 71.A O no hydrogen 3.052 N/A LYS 112.A NZ ASP 76.A OD2 no hydrogen 2.908 N/A LEU 113.A N ALA 109.A O no hydrogen 3.079 N/A ILE 114.A N MET 110.A O no hydrogen 2.899 N/A ALA 115.A N ASN 111.A O no hydrogen 2.902 N/A GLN 116.A N LYS 112.A O no hydrogen 2.962 N/A GLN 116.A NE2 GLN 58.A OE1 no hydrogen 2.892 N/A LEU 117.A N LEU 113.A O no hydrogen 3.195 N/A LEU 117.A N ILE 114.A O no hydrogen 3.025 N/A GLY 118.A N ALA 115.A O no hydrogen 2.977 N/A GLY 119.A N ILE 114.A O no hydrogen 2.930 N/A GLY 122.A N GLY 119.A O no hydrogen 2.837 N/A VAL 123.A N PRO 120.A O no hydrogen 2.933 N/A THR 124.A N PRO 120.A O no hydrogen 3.207 N/A THR 124.A OG1 LEU 137.A O no hydrogen 3.205 N/A ALA 125.A N GLY 121.A O no hydrogen 2.823 N/A PHE 126.A N GLY 122.A O no hydrogen 3.221 N/A ALA 127.A N VAL 123.A O no hydrogen 3.064 N/A ARG 128.A N THR 124.A O no hydrogen 2.950 N/A ARG 128.A NH1 ASP 132.A O no hydrogen 2.851 N/A ARG 128.A NH1 PHE 135.A O no hydrogen 2.766 N/A ARG 128.A NH2 PHE 135.A O no hydrogen 3.068 N/A ALA 129.A N ALA 125.A O no hydrogen 2.980 N/A ILE 130.A N PHE 126.A O no hydrogen 3.135 N/A ILE 130.A N ALA 127.A O no hydrogen 3.131 N/A GLY 131.A N ARG 128.A O no hydrogen 3.069 N/A ASP 132.A N ALA 127.A O no hydrogen 2.923 N/A THR 134.A N ASP 132.A OD1 no hydrogen 2.936 N/A PHE 135.A N ASP 132.A OD1 no hydrogen 2.908 N/A ARG 136.A N THR 155.A O no hydrogen 3.159 N/A ARG 136.A NE ASP 138.A OD2 no hydrogen 2.915 N/A ARG 136.A NH2 ASP 138.A OD1 no hydrogen 2.977 N/A ARG 136.A NH2 ASP 138.A OD2 no hydrogen 3.565 N/A LEU 137.A N THR 124.A OG1 no hydrogen 2.948 N/A ASP 138.A N ASP 154.A OD1 no hydrogen 2.694 N/A ARG 139.A N ASP 154.A OD1 no hydrogen 3.082 N/A ARG 139.A NE ASP 154.A OD2 no hydrogen 2.768 N/A ARG 139.A NH1 THR 146.A OG1 no hydrogen 2.855 N/A ARG 139.A NH2 THR 146.A OG1 no hydrogen 3.089 N/A ARG 139.A NH2 ASP 154.A OD2 no hydrogen 2.818 N/A GLU 141.A N ASN 111.A OD1 no hydrogen 2.815 N/A THR 143.A OG1 THR 140.A O no hydrogen 3.554 N/A LEU 144.A N THR 140.A O no hydrogen 2.984 N/A ASN 145.A N PRO 142.A O no hydrogen 3.074 N/A ASN 145.A ND2 GLU 141.A OE2 no hydrogen 2.744 N/A ASN 145.A ND2 PRO 142.A O no hydrogen 3.229 N/A THR 146.A N THR 143.A O no hydrogen 3.199 N/A THR 146.A OG1 THR 143.A O no hydrogen 3.323 N/A ASP 151.A N ILE 148.A O no hydrogen 3.033 N/A ARG 153.A N ASP 151.A OD1 no hydrogen 2.986 N/A ARG 153.A NE ASP 151.A OD1 no hydrogen 3.119 N/A ARG 153.A NE ASP 151.A OD2 no hydrogen 3.101 N/A ARG 153.A NH2 ASP 151.A OD2 no hydrogen 2.681 N/A ASP 154.A N ASP 138.A OD2 no hydrogen 2.917 N/A THR 155.A OG1 PRO 152.A O no hydrogen 2.623 N/A THR 156.A N PHE 41.A O no hydrogen 3.152 N/A ARG 159.A N GLY 37.A O no hydrogen 2.969 N/A ARG 159.A NE ASP 38.A OD1 no hydrogen 2.767 N/A ARG 159.A NH2 ASP 38.A OD2 no hydrogen 2.868 N/A ALA 160.A N THR 157.A OG1 no hydrogen 3.102 N/A MET 161.A N THR 157.A O no hydrogen 3.043 N/A ALA 162.A N PRO 158.A O no hydrogen 2.977 N/A GLN 163.A N ARG 159.A O no hydrogen 3.121 N/A THR 164.A N ALA 160.A O no hydrogen 3.003 N/A THR 164.A OG1 ASP 132.A OD2 no hydrogen 2.618 N/A THR 164.A OG1 ALA 160.A O no hydrogen 3.197 N/A LEU 165.A N MET 161.A O no hydrogen 2.798 N/A ARG 166.A N ALA 162.A O no hydrogen 2.960 N/A ARG 166.A NH1 ASN 30.A OD1 no hydrogen 3.173 N/A ARG 166.A NH2 ASN 30.A OD1 no hydrogen 2.884 N/A GLN 167.A N GLN 163.A O no hydrogen 3.004 N/A LEU 168.A N THR 164.A O no hydrogen 2.891 N/A THR 169.A N LEU 165.A O no hydrogen 2.940 N/A THR 169.A OG1 LEU 165.A O no hydrogen 2.752 N/A LEU 170.A N ARG 166.A O no hydrogen 2.852 N/A GLY 171.A N ARG 166.A O no hydrogen 2.895 N/A ALA 173.A N GLN 167.A O no hydrogen 3.173 N/A GLY 175.A N GLU 60.A OE2 no hydrogen 2.826 N/A ARG 179.A N GLY 175.A O no hydrogen 2.822 N/A ARG 179.A NH1 GLY 171.A O no hydrogen 3.116 N/A ALA 180.A N GLU 176.A O no hydrogen 3.014 N/A GLN 181.A N THR 177.A O no hydrogen 2.997 N/A LEU 182.A N GLN 178.A O no hydrogen 2.920 N/A VAL 183.A N ARG 179.A O no hydrogen 2.976 N/A THR 184.A N ALA 180.A O no hydrogen 2.923 N/A THR 184.A OG1 ALA 180.A O no hydrogen 2.998 N/A TRP 185.A N GLN 181.A O no hydrogen 2.927 N/A LEU 186.A N LEU 182.A O no hydrogen 2.956 N/A LYS 187.A N VAL 183.A O no hydrogen 2.880 N/A GLY 188.A N THR 184.A O no hydrogen 3.119 N/A GLY 188.A N TRP 185.A O no hydrogen 3.108 N/A ASN 189.A N LEU 186.A O no hydrogen 3.108 N/A ASN 189.A ND2 THR 191.A OG1 no hydrogen 3.064 N/A ASN 189.A ND2 ASP 208.A OD1 no hydrogen 2.936 N/A ASN 189.A ND2 ASP 208.A OD2 no hydrogen 3.307 N/A THR 190.A N GLN 103.A O no hydrogen 3.118 N/A THR 190.A OG1 GLN 103.A O no hydrogen 2.680 N/A THR 191.A N ASN 189.A OD1 no hydrogen 3.214 N/A THR 191.A OG1 ASN 189.A OD1 no hydrogen 3.135 N/A THR 191.A OG1 THR 210.A OG1 no hydrogen 2.703 N/A SER 195.A N GLY 192.A O no hydrogen 3.161 N/A ILE 196.A N ASP 220.A OD2 no hydrogen 2.982 N/A ARG 197.A NH1.A ASP 208.A OD1 no hydrogen 2.896 N/A ARG 197.A NH1.B ALA 206.A O no hydrogen 2.962 N/A ALA 198.A N SER 195.A O no hydrogen 3.005 N/A GLY 199.A N ILE 196.A O no hydrogen 2.908 N/A LEU 200.A N ARG 197.A O no hydrogen 3.208 N/A SER 203.A OG GLN 227.A OE1.A no hydrogen 2.910 N/A TRP 204.A N PRO 201.A O no hydrogen 3.050 N/A THR 205.A N TRP 225.A O no hydrogen 3.168 N/A GLY 207.A N VAL 223.A O no hydrogen 2.921 N/A ASP 208.A N LEU 186.A O no hydrogen 3.183 N/A LYS 209.A N ILE 221.A O no hydrogen 2.902 N/A LYS 209.A NZ SER 105.A OG no hydrogen 2.835 N/A LYS 209.A NZ THR 210.A O no hydrogen 2.774 N/A THR 210.A OG1 THR 191.A OG1 no hydrogen 2.703 N/A GLY 211.A N ASN 219.A O no hydrogen 2.914 N/A GLY 213.A N THR 217.A O no hydrogen 2.980 N/A ASP 214.A N ASN 145.A O no hydrogen 3.053 N/A TYR 215.A N GLN 243.A O no hydrogen 2.847 N/A THR 217.A N ASP 214.A O no hydrogen 3.094 N/A THR 217.A OG1 ASP 214.A O no hydrogen 2.706 N/A THR 217.A OG1 THR 239.A OG1 no hydrogen 2.781 N/A THR 218.A N PHE 238.A O no hydrogen 2.834 N/A THR 218.A OG1 GLY 216.A O no hydrogen 2.890 N/A ASN 219.A N GLY 211.A O no hydrogen 2.879 N/A ASN 219.A ND2 PRO 42.A O no hydrogen 2.829 N/A ASN 219.A ND2 MET 43.A O no hydrogen 3.008 N/A ASP 220.A N THR 236.A O no hydrogen 2.942 N/A ILE 221.A N LYS 209.A O no hydrogen 3.028 N/A ALA 222.A N LEU 234.A O no hydrogen 2.777 N/A VAL 223.A N GLY 207.A O no hydrogen 3.022 N/A ILE 224.A N LEU 232.A O no hydrogen 2.796 N/A TRP 225.A N THR 205.A O no hydrogen 2.793 N/A ARG 229.A N PRO 226.A O no hydrogen 3.343 N/A ARG 229.A NH2.A ASP 26.A OD2 no hydrogen 2.948 N/A LEU 232.A N ILE 224.A O no hydrogen 2.797 N/A VAL 233.A N ILE 25.A O no hydrogen 2.915 N/A LEU 234.A N ALA 222.A O no hydrogen 2.858 N/A VAL 235.A N ALA 23.A O no hydrogen 2.864 N/A THR 236.A N ASP 220.A O no hydrogen 2.886 N/A THR 236.A OG1 ASP 220.A O no hydrogen 3.409 N/A TYR 237.A N GLY 21.A O no hydrogen 2.779 N/A TYR 237.A OH THR 46.A OG1 no hydrogen 2.932 N/A PHE 238.A N ASN 219.A OD1 no hydrogen 3.199 N/A THR 239.A N ARG 19.A O no hydrogen 3.009 N/A THR 239.A OG1 THR 217.A OG1 no hydrogen 2.781 N/A GLN 240.A N TYR 215.A O no hydrogen 2.786 N/A GLN 240.A NE2 GLY 216.A O no hydrogen 2.953 N/A GLN 240.A NE2 GLU 246.A O no hydrogen 2.796 N/A ALA 245.A N GLN 242.A O no hydrogen 3.078 N/A ARG 248.A N THR 218.A OG1 no hydrogen 3.062 N/A ARG 248.A NE ASP 250.A OD1 no hydrogen 2.801 N/A ARG 248.A NH2 ASP 250.A OD2 no hydrogen 2.817 N/A VAL 251.A N ARG 248.A O no hydrogen 3.017 N/A ALA 253.A N ARG 249.A O no hydrogen 3.011 N/A SER 254.A N ASP 250.A O no hydrogen 2.897 N/A SER 254.A OG ASP 250.A O no hydrogen 3.082 N/A ALA 255.A N VAL 251.A O no hydrogen 2.925 N/A ALA 256.A N LEU 252.A O no hydrogen 2.934 N/A ARG 257.A N ALA 253.A O no hydrogen 2.915 N/A ARG 257.A NH1 ALA 198.A O no hydrogen 3.273 N/A ILE 258.A N SER 254.A O no hydrogen 3.021 N/A ILE 259.A N ALA 255.A O no hydrogen 3.004 N/A ALA 260.A N ALA 256.A O no hydrogen 2.851 N/A GLU 261.A N ARG 257.A O no hydrogen 2.899 N/A GLY 262.A N ILE 258.A O no hydrogen 3.019 N/A GLY 262.A N ILE 259.A O no hydrogen 3.231 N/A LEU 263.A N ALA 260.A O no hydrogen 3.411 N/A